3,6-bis(azanyl)-N-butan-2-yl-5-cyano-4-(4-methylphenyl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3,6-bis(azanyl)-N-butan-2-yl-5-cyano-4-(4-methylphenyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3,6-diamino-5-cyano-4-(p-tolyl)-N-sec-butyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3,6-diamino-N-butan-2-yl-5-cyano-4-(4-methylphenyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3,6-diamino-N-butan-2-yl-5-cyano-4-(4-methylphenyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3,6-diamino-5-cyano-4-(p-tolyl)-N-sec-butyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C2=C(S1)N=C(C(=C2C3=CC=C(C=C3)C)C#N)N)N

Isomeric SMILES

CCC(C)NC(=O)C1=C(C2=C(S1)N=C(C(=C2C3=CC=C(C=C3)C)C#N)N)N

InChI

InChI=1S/C20H21N5OS/c1-4-11(3)24-19(26)17-16(22)15-14(12-7-5-10(2)6-8-12)13(9-21)18(23)25-20(15)27-17/h5-8,11H,4,22H2,1-3H3,(H2,23,25)(H,24,26)